SCHEMBL26072721

SCHEMBL26072721

Cc1nc(Cl)cc2c1cc(-c1ccc(S(C)(=O)=O)cc1)n2C1CC1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 13/20 0.47
▸ PTGS1 P23219 4/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ JAK2 O60674 1/20 0.37
▸ JAK1 P23458 1/20 0.37
▸ TYK2 P29597 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ CTSS P25774 1/20 0.37
▸ TGFBR1 P36897 3/20 0.36
▸ KDR P35968 2/20 0.36
▸ MAPK14 Q16539 2/20 0.36
▸ PSD A5PKW4 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29395846 0.82 PTGS2 (0.41) PTGS2PTGS1IDO1
SCHEMBL26072684 0.82 PTGS2 (0.41) PTGS2PTGS1IDO1
SCHEMBL29394173 0.81 PTGS2 (0.43) PTGS2PTGS1TGFBR1KDRMAPK14
SCHEMBL26072088 0.81 PTGS2 (0.43) PTGS2PTGS1TGFBR1KDRMAPK14
SCHEMBL26072817 0.81 PTGS2 (0.46) PTGS2PTGS1IDO1TGFBR1KDR
SCHEMBL26072089 0.78 PTGS2 (0.40) PTGS2PTGS1IDO1
SCHEMBL26072738 0.75 KCNH2 (0.34) PTGS2
SCHEMBL26072351 0.75 CCR2 (0.38) PTGS2JAK2JAK1TYK2JAK3
SCHEMBL31576213 0.75 CCR2 (0.38) PTGS2JAK2JAK1TYK2JAK3
SCHEMBL29395772 0.73 CCR2 (0.44) JAK2JAK3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590091-B2 1H-pyrrolo[3,2-C]pyridine and 1H-pyrrolo[2,3-C]pyridine derivatives as TLR9 inhibitors for the treatment of fibrosis BRISTOL-MYERS SQUIBB COMPANY (US) 2026-03-31 — — US disclosed
EP-4200298-B1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2025-05-21 — — EP disclosed
US-20230312565-A1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2023-10-05 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-12590091-B2 1H-pyrrolo[3,2-C]pyridine and 1H-pyrrolo[2,3-C]pyridine derivatives as TLR9 inhibitors for the treatment of fibrosis TLR9, TLR1, TLR3 PTGS2 1438/4885PTGS1 629/4885IDO1 550/4885
US-20230312565-A1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 PTGS2 1061/4885PTGS1 356/4885IDO1 326/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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